| SpectraBase Compound ID | 9tJljBszVAD |
|---|---|
| InChI | InChI=1S/C13H25NO/c1-4-7-8-9-10-13(15)14(11-5-2)12-6-3/h7-8H,4-6,9-12H2,1-3H3/b8-7+ |
| InChIKey | BOIRRFOBAJYPMS-BQYQJAHWSA-N |
| Mol Weight | 211.35 g/mol |
| Molecular Formula | C13H25NO |
| Exact Mass | 211.193614 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JqMxrDvIbEg |
|---|---|
| Name | Hept-4-enoylamide, N,N-dipropyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 211.193614428 u |
| Formula | C13H25NO |
| InChI | InChI=1S/C13H25NO/c1-4-7-8-9-10-13(15)14(11-5-2)12-6-3/h7-8H,4-6,9-12H2,1-3H3/b8-7+ |
| InChIKey | BOIRRFOBAJYPMS-BQYQJAHWSA-N |
| Molecular Weight | 211.349 g/mol |
| SMILES | C(\C=C\CCC(N(CCC)CCC)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.858095 |